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Analysis: C18 NEGATIVE ION MODE/QTOF

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
16:0 LYSO PC (M+HCOO)-LPC 16:0ME223296460602-22.251495.3323
18:0 LYSO-PE (M-H)-LPE 18:0ME2232669547068-22.687481.3176
2,4-DIHYDROXYPTERIDINE (M-H)-LumazineME22335810250-1.55164.032
2-DEOXY-D-GLUCOSE (M+Cl)-2-Deoxy-glucoseME223332439268-0.736164.0686
2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)-2-Hydroxy-3-methylbutyric acidME223262853180-3.41118.0627
2-OXOADIPIC ACID (M-H)-Oxoadipic acidME22334471-1.332160.0368
3-(4-HYDROXYPHENYL)LACTIC ACID (M-H)-Hydroxyphenyllactic acidME223338440177-3.755182.0578
3-DEHYDROSHIKIMIC ACID (M-H)-3-DehydroshikimateME223350439774-1.022172.0355
3-HYDROXY-3-METHYLGLUTARIC ACID (M-H)-3-Hydroxymethylglutaric acidME2233361662-1.58162.0516
3-METHYLXANTHINE (M-H)-3-MethylxanthineME22334170639-2.436166.0494
4-HYDROXYBENZOIC ACID (M-H)-4-Hydroxybenzoic acidME223285135-4.068138.0315
4-NITROPHENOL (M-H)-4-NitrophenolME223303980-6.991139.0267
4-PYRIDOXIC ACID (M-H)-4-Pyridoxic acidME2232836723-1.832183.053
5'-METHYLTHIOADENOSINE (M+Cl)-5'-MethylthioadenosineME223345439176-4.458297.0889
5-OXOPROLINE (M-H)-Pyroglutamic acidME2232877405-1.164129.0424
ADIPIC ACID (M-H)-Adipic acidME223273196-3.578146.0582
ALPHA-HYDROXYISOBUTYRIC ACID (M-H)-2-Hydroxyisobutyric acidME22332511671-1.713104.0474
ALPHA-KETO-GLUTARIC ACID (M-H)-2-Oxoglutaric acidME22334351-0.91146.0215
ALPHA-LINOLENIC ACID (M+HCOO)-alpha-Linolenic acidME2233015280934-22.852278.2222
ARACHIDIC ACID (M-H)-Arachidic acidME22329110467-23.575312.3028
ARACHIDONIC ACID (M-H)-Arachidonic acidME223259444899-22.709304.2405
AZELAIC ACID (M-H)-Azelaic acidME2233022266-10.635188.1046
BEHENIC ACID (M-H)-Behenic acidME2233308215-24.062340.3331
BENZOIC ACID (M-H)-Benzoic acidME223272243-4.906122.0366
BILIVERDIN (M-H)-BiliverdinME2232765280353-18.594582.253
CARNOSINE (M-H)-CarnosineME223342439224-0.629226.1065
CHOLIC ACID (M-H)-Cholic acidME223331221493-20.259408.2847
CIS-11-EICOSENOIC ACID (M-H)-cis-Gondoic acidME2232655282768-23.252310.287
CIS-7,10,13,16-DOCOSATETRAENOIC ACID (M+HCOO)-Adrenic acidME2233565497181-23.254332.2735
CITRAMALIC ACID (M-H)-Citramalic acidME223269441696-1.383148.0366
CITRIC ACID (M-H)-Citric acidME223288311-1.018192.0269
CORTICOSTERONE (M+Cl)-CorticosteroneME2233045753-15.328346.2104
CORTISOL (M+Cl)-CortisolME2233285754-13.721362.2083
CORTISOL (M+HCOO)-CortisolME2233295754-13.722362.2086
CORTISONE (M+Cl)-CortisoneME223279222786-13.305360.1921
CREATINE (M-H)-CreatineME223354586-0.701131.069
DEHYDROASCORBIC ACID (M-H)-L-Dehydroascorbic acidME223286440667-0.787174.0161
DEOXYURIDINE (M+Cl)-DeoxyuridineME22334613712-1.686228.0723
DOCOSAHEXAENOIC ACID (M-H)-Docosahexaenoic acidME223295445580-22.696328.2404
EPIBRASSINOLIDE [ISTD] (M+HCOO)-24-epi-BrassinolideME2233103239-19.759480.3463
ERUCIC ACID (M-H)-cis-Erucic acidME2232685281116-23.646338.3185
FUMARIC ACID (2M-H)-Fumaric acidME223348444972-1.25116.0108
FUMARIC ACID (M-H)-Fumaric acidME223353444972-1.25116.0111
GLUCONIC ACID (M-H)-Gluconic acidME22334010690-0.765196.0571
GLUCOSE (M+Cl)-GlucoseME2233175793-0.691180.0643
GLUTATHIONE (OXIDIZED) (M-H)-GlutathioneME22334765359-1.361612.1519
GLYCERIC ACID (M-H)-Glyceric acidME223299439194-0.75106.0266
HEPTADECANOIC ACID (M-H)-Margaric acidME22327710465-23.011270.2556
HIPPURIC ACID (M-H)-Hippuric acidME223274464-4.718179.0581
HYODEOXYCHOLIC ACID (M-H)-Hyodeoxycholic acidME2232825283820-22.9392.2958
IBUPROFEN CARBOXYLIC ACID (M-H)--ME22332210444113-12.927236.1064
IBUPROFEN (M-H)-IbuprofenME223333114864-18.812206.1304
INOSINE 5'-PHOSPHATE (M-H)-IMPME2232788582-0.987348.0475
INOSINE (M+Cl)-InosineME2232976021-1.82268.0808
INOSINE (M-H)-InosineME2232986021-1.82268.0808
ISOCITRIC ACID (M-H)-Isocitric acidME2233375318532-0.748192.0269
L-[15N]ANTHRANILIC ACID [ISTD] (M-H)-2-Aminobenzoic acidME223316227-5.287138.0446
LAURIC ACID (M-H)-Lauric acidME2233053893-21.741200.1771
LIGNOCERIC ACID (M-H)-Lignoceric acidME22328011197-24.704368.3652
LINOLEIC ACID (M-H)-Linoleic acidME2233215280450-22.723280.2407
L-TRYPTOPHAN-15N2 [ISTD] (M-H)-TryptophanME22329316217285-3.607206.0838
MALEIC ACID (M-H)-Maleic acidME223349444266-1.098116.0111
MALIC ACID (M-H)-Malic acidME223314222656-0.751134.0217
MALIC ACID (M-H)+[-H2O]Malic acidME223352222656-0.75134.0229
MANDELIC ACID #2 (M-H)-Mandelic acidME22331111914-8.648152.0475
METHYLMALONIC ACID (M-H)-Methylmalonic acidME223309487-1.489118.0267
MYRISTIC ACID (M-H)-Myristic acidME22327011005-22.453228.2088
MYRISTOLEIC ACID (M-H)-Myristoleic acidME2233265281119-22.075226.1932
N-ACETYL-L-ALANINE (M-H)-N-AcetylalanineME22330688064-1.493131.0588
NAD (M-H)-NAD+ME2233515893-1.034663.1092
NERVONIC ACID (M-H)-Nervonic acidME2232845281120-24.133366.3488
OLEOYL-GLYCEROL (M+HCOO)-MG 18:1ME2233185319879-22.658356.2926
OXALOACETIC ACID (M-H)-[-H2O]Oxaloacetic acidME223339970-0.566132.0034
PALMITIC ACID (M-H)-Palmitic acidME223307985-22.852256.2406
PALMITOLEIC ACID (M-H)-Palmitoleic acidME223315445638-22.591254.2246
PANTOTHENIC ACID (M+Cl)-Pantothenic acidME2232646613-3.196219.1105
PANTOTHENIC ACID (M-H)-Pantothenic acidME2233206613-3.197219.1106
PHENYLALANINE (M-H)-PhenylalanineME2232676140-2.486165.0785
PHOSPHOCREATINE (M-H)-PhosphocreatineME2233559548602-0.835211.036
PHTHALIC ACID (M-H)-Phthalic acidME2233341017-4.722166.0256
PHYTANIC ACID (M-H)-Phytanic acidME22326110380830-23.257312.3019
PYRUVIC ACID (M-H)-Pyruvic acidME2233351060-0.74288.0163
RETINOIC ACID (M-H)-Retinoic acidME223308444795-22.269300.2105
SALICYLATE #2 (M-H)-Salicylic acidME223327338-8.134138.0316
STEARIC ACID (M-H)-Stearic acidME2232755281-23.18284.272
SUBERIC ACID (M-H)-Suberic acidME22326010457-8.145174.0884
SUCCINIC ACID (M-H)-Succinic acidME2232891110-1.302118.0266
THEOPHYLLINE (M-H)-TheophyllineME2232632153-4.4180.0631
THYMINE-D4(METHYL-D3,6-D1) [ISTD] (M-H)--ME22335716213347-1.681130.0678
TRANS-ACONITIC ACID (M-H)-trans-Aconitic acidME223292444212-1.125174.0166
TRANS-VACCENIC ACID (M-H)-trans-Vaccenic acidME2233005281127-22.93282.2565
TRICARBALLYLIC ACID (M-H)-[-H2O]1,2,3-Propanetricarboxylic acidME22331914925-1.349176.0319
TRICOSANOIC ACID (M-H)-Tricosylic acidME22328117085-24.356354.3494
TRYPTOPHAN (M-H)-TryptophanME2232946305-3.599204.0865
TYROSINE (M-H)-TyrosineME2232716057-1.357181.0718
URIC ACID (M-H)-Uric acidME2233131175-1.041168.0274
URIDINE (M+Cl)-UridineME2233246029-1.37244.0697
URIDINE (M-H)-UridineME2232906029-1.37244.0692
URSODIOL (M+HCOO)-Ursodeoxycholic acidME22332331401-21.566392.2918
ZEATIN [ISTD] (M+Cl)-trans-ZeatinME223312449093-3.875219.112


Analysis: C18 POSITIVE ION MODE/QTOF

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
16:0 LYSO PC (M+H)+LPC 16:0ME223379460602-22.252495.3327
16:0 LYSO PC (M+Na)+LPC 16:0ME223440460602-22.266495.3334
18:0 LYSO-PE (M+H)+LPE 18:0ME2234659547068-22.689481.3214
18:0 LYSO-PE (M+Na)+LPE 18:0ME2234569547068-22.69481.3249
1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID (M+H)+1-Aminocyclopropanecarboxylic acidME223411535-0.978101.0473
1-METHYLADENOSINE (M+H)+1-MethyladenosineME22337727476-2.99281.1143
3',5'-CYCLIC AMP (M+H)+3',5' cyclic AMPME2234746076-1.921329.0537
3-DEHYDROXYCARNITINE (M+H)+3-DehydroxycarnitineME223452725-0.7145.1089
3-HYDROXYLAUROYLCARNITINE (*) (M+H)+CAR 12:0;OHME22343571464535-15.999359.2677
3-METHOXYTYROSINE (M+H)+3-MethoxytyrosineME2234339307-2.005211.0843
3-METHYLHISTAMINE (M+H)+3-MethylhistamineME22344869520-0.564125.0941
5ALPHA-ANDROSTANE-3ALPHA,17BETA-DIOL (M+Na)+3alpha-AndrostanediolME22347315818-19.418292.2412
5-AMINOPENTANOIC ACID (M+H)+5-Aminopentanoic acidME223464138-0.736117.0783
5'-METHYLTHIOADENOSINE (M+H)+5'-MethylthioadenosineME223461439176-4.463297.0902
ACETYLCARNITINE (M+H)+CAR 2:0ME22343718230-0.978203.1151
ADIPIC ACID (M+Na)+Adipic acidME223400196-3.483146.0585
ALPHA-TOCOPHEROL (M+H)+alpha-TocopherolME22342514985-24.474430.3794
AZELAIC ACID (M+H)+[-H2O]Azelaic acidME2234272266-10.656188.1052
AZELAIC ACID (M+Na)+Azelaic acidME2233802266-10.654188.1067
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (M+H)+AnserineME223460112072-0.632240.119
BILIVERDIN (M+H)+BiliverdinME2233995280353-18.613582.248
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+Na)+bis(2-Ethylhexyl)phthalic acidME2233878343-23.106390.278
CAFFEINE (M+H)+CaffeineME2234712519-5.838194.0819
CARNITINE (M+H)+CarnitineME22344410917-0.681161.104
CARNOSINE (M+H)+CarnosineME223466439224-0.634226.1044
CARNOSINE (M+Na)+CarnosineME223366439224-0.632226.1035
CHOLESTEROL (M+H)+[-H2O]CholesterolME2233785997-24.542386.3551
CITRIC ACID (M+Na)+Citric acidME223375311-1.033192.0254
CITRULLINE (M+Na)+CitrullineME2234679750-0.63175.0962
CORTICOSTERONE (M+Na)+CorticosteroneME2234205753-15.316346.2162
CORTISOL (M+H)+CortisolME2233625754-13.734362.2071
CORTISOL (M+Na)+CortisolME2233945754-13.739362.2047
CORTISONE (M+H)+CortisoneME223382222786-13.325360.191
CORTISONE (M+Na)+CortisoneME223418222786-13.327360.1987
CREATINE (M+H)+CreatineME223450586-0.696131.0688
DECANOIC ACID (2M+Na)+Capric acidME2234232969-22.812172.1465
DEHYDROEPIANDROSTERONE (M+H)+DehydroepiandrosteroneME2233905881-17.265288.2067
DEHYDROEPIANDROSTERONE SULFATE M+[-HSO4]Dehydroepiandrosterone sulfateME22336812594-14.937368.1642
DESMOSTEROL (M+H)+[-H2O]DesmosterolME223360439577-24.234384.339
DIPALMITOYL-GLYCEROL (M+H)+[-H2O]DG 16:0_16:0ME223408644078-26.061568.5064
DIPALMITOYL-GLYCEROL (M+Na)+DG 16:0_16:0ME223401644078-26.06568.5075
DODECENOYLCARNITINE (*) II M+CAR 12:1ME22339353481671-16.723342.2637
EICOSADIENOYLCARNITINE (*) (M+H)+CAR 20:2ME22347071464509-21.461451.3592
EICOSANOYLCARNITINE (*) (M+H)+CAR 20:0ME22338453477833-22.067455.3973
FLUCYTOSINE (M+H)+FlucytosineME2233893366-0.652129.0349
GLUCOSE (M+Na)+GlucoseME2233725793-0.664180.0624
GLUTATHIONE OXIDIZED (M+H2)+2GlutathioneME22346365359-1.356612.1534
GLYCEROL MYRISTATE (M+Na)+MG 14:0ME22341579050-22.145302.2448
GLYCOCHOLIC ACID (M+H)+Glycocholic acidME22343210140-18.8465.3093
GUANINE (M+H)+GuanineME223468764-0.916151.0489
GUANOSINE (M+H)+GuanosineME2234596802-1.833283.0927
HEXANOYLCARNITINE (*) M+CAR 6:0ME2234343246939-7.06260.1885
HIPPURIC ACID (M+H)+Hippuric acidME223419464-4.731179.0588
HISTAMINE (M+H)+HistamineME223454774-0.555111.0799
HISTAMINE (M+Na)+HistamineME223451774-0.573111.0796
HYPOXANTHINE (M+H)+HypoxanthineME223438790-1.021136.0385
IBUPROFEN CARBOXYLIC ACID (M+Na)+-ME22339710444113-12.898236.1055
INDOLE-3-ACETIC ACID (M+H)+Indoleacetic acidME223436802-8.332175.0642
INOSINE 5'-PHOSPHATE (M+H)+IMPME2233648582-0.992348.047
INOSINE 5'-PHOSPHATE (M+Na)+IMPME2233718582-0.986348.0468
INOSINE (M+Na)+InosineME2234176021-1.734268.0813
ISO-BUTYRYLCARNITINE (*) (M+H)+CAR 3:0;2MeME223359168379-2.912231.1475
ISOVALERYLCARNITINE (*) (M+H)+CAR 4:0;3MeME223365169235-4.583245.1629
KYNURENIC ACID (M+H)+Kynurenic acidME2234313845-4.913189.0444
KYNURENINE (M+H)+KynurenineME223386161166-2.204208.0808
L-ARGININE (M+H)+ArginineME2234396322-0.632174.1106
L-ARGININE (M+Na)+ArginineME2233856322-0.642174.1084
LEUCINE (M+H)+LeucineME2233636106-1.52131.0948
L-HISTIDINE (M+H)+HistidineME2234456274-0.625155.068
L-HISTIDINE (M+Na)+HistidineME2234466274-0.627155.0685
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+TryptophanME22341216217285-3.606206.0847
LYSINE (M+H)+LysineME2234215962-0.562146.1055
LYSINE (M+Na)+LysineME2234075962-0.576146.1046
METHIONINE (M+H)+MethionineME2234286137-1.012149.0506
METHYL BETA-D-GALACTOSIDE (M+Na)+Methyl beta-D-galactosideME22337094214-0.714194.0793
N6,N6,N6-TRIMETHYL-L-LYSINE (M+H)+N-6-TrimethyllysineME223472440120-0.651188.1523
N-ACETYL-DL-SERINE (M+H)+N-AcetylserineME22345365249-0.775147.0557
N-ACETYL-DL-SERINE (M+H)+[-H2O]N-AcetylserineME22342465249-0.827147.0534
N-ACETYL-D-TRYPTOPHAN (M+H)+N-Acetyl-D-tryptophanME223442439917-7.895246.0984
N-ACETYL-D-TRYPTOPHAN (M+Na)+N-Acetyl-D-tryptophanME223447439917-7.902246.103
NAD (M+H)+NAD+ME2234305893-1.03663.1081
N-ALPHA-ACETYL-L-LYSINE (M+H)+N(2)-AcetyllysineME22345592907-0.721188.1179
NAPROXEN (M+H)+NaproxenME223392156391-15.701230.0945
N-CYCLOHEXYLFORMAMIDE (M+H)+N-CyclohexylformamideME22341313017-7.811127.1006
NICOTINAMIDE (M+H)+NiacinamideME223395936-1.103122.0479
NORADRENALINE (M+H)+[-H2O]Xi-NorepinephrineME223457951-0.669169.0728
OCTANOYLCARNITINE (*) (M+H)+CAR 8:0ME223373123701-11.761287.2109
OCTENOYLCARNITINE (*) M+CAR 8:1ME22336771464472-9.587286.2027
OLEAMIDE (M+H)+OleamideME2233985283387-22.622281.2709
OLEAMIDE (M+Na)+OleamideME2234495283387-22.623281.2724
OLEIC ACID (M+Na)+Oleic acidME223388445639-22.536282.2568
OLEOYL-GLYCEROL (M+H)+MG 18:1ME2234105319879-22.675356.2903
OLEOYL-GLYCEROL (M+Na)+MG 18:1ME2234295319879-22.713356.2933
OPHTHALMIC ACID (M+H)+Ophthalmic acidME2234627018721-1.208289.1262
ORNITHINE (M+H)+OrnithineME2234046262-0.561132.0901
PANTOTHENIC ACID (M+H)+Pantothenic acidME2233916613-3.202219.1114
PANTOTHENIC ACID (M+Na)+Pantothenic acidME2234416613-3.202219.1114
PHENYLALANINE (M+H)+PhenylalanineME2234436140-2.528165.079
PHOSPHOCREATINE (M+H)+PhosphocreatineME2234699548602-0.881211.0352
PROLINE (M+H)+ProlineME223406145742-0.711115.0629
PROPIONYLCARNITINE (*) (M+H)+CAR 3:0ME223416107738-1.673217.1316
PYRIDOXAL (M+H)+[-H2O]PyridoxalME2234261050-1.012167.0608
S-ADENOSYL-L-HOMOCYSTEINE (M+H)+S-AdenosylhomocysteineME223409439155-1.551384.1237
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+sn-Glycero-3-phosphocholineME223403439285-0.681257.1025
SUBERIC ACID (M+Na)+Suberic acidME22342210457-8.162174.0915
TETRADECENOYLCARNITINE (*) M+CAR 14:1ME22340222833575-18.839370.2964
THEOBROMINE (M+H)+TheobromineME2233835429-3.481180.0656
THYROXINE (M+H)+ThyroxineME2233695819-16.22776.6859
TRIMETHYLAMINE (M+H)+TrimethylamineME2234581146-0.71759.0732
TRYPTOPHAN (M+H)+TryptophanME2234146305-3.587204.0867
TRYPTOPHAN (M+Na)+TryptophanME2234056305-3.587204.087
TYROSINE (M+H)+TyrosineME2233966057-1.348181.0738
URIC ACID (M+H)+Uric acidME2233761175-1.047168.0269
URIDINE (M+Na)+UridineME2233746029-1.358244.0676
VALINE (M+H)+ValineME2233616287-0.91117.0789
ZEATIN [ISTD] (M+H)+trans-ZeatinME223381449093-3.881219.113


Analysis: C18 NEGATIVE ION MODE/Triple TOF

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Arachidonic acidArachidonic acidME223475444899-1.76303.2329
CerP 32:1; [M-H]-@5.12CerP 32:1;O2ME223505--5.12588.4393
CerP 33:1; [M-H]-@5.49CerP 33:1;O2ME223506--5.49602.4549
CerP 34:1; [M-H]-@5.83CerP 34:1;O2ME223507--5.83616.4706
CerP 34:1; [M-H]-@5.84CerP 34:1;O2ME223508--5.84616.4706
CerP 34:2; [M-H]-@5.29CerP 34:2;O2ME223509--5.29614.4549
CerP 35:1; [M-H]-@6.15CerP 35:1;O2ME223510--6.15630.4863
CerP 40:1; [M-H]-@7.69CerP 40:1;O2ME223511--7.69700.5645
CerP 42:1; [M-H]-@8.17CerP 42:1;O2ME223512--8.17728.5958
CerP 42:1; [M-H]-@8.27CerP 42:1;O2ME223513--8.27728.5958
CerP 42:2; [M-H]-@7.66CerP 42:2;O2ME223514--7.66726.5801
CerP 42:2; [M-H]-@7.71CerP 42:2;O2ME223515--7.71726.5801
CL 66:1; [M-2H](2-)@6.22CL 66:1ME223476--6.22688.4861
CL 70:1; [M-2H](2-)@6.02CL 70:1ME223477--6.02716.5174
CL 70:1; [M-2H](2-)@6.12CL 70:1ME223478--6.12716.5174
CL 70:5; [M-2H](2-)@5.92CL 70:5ME223479--5.92712.4861
CL 70:5; [M-2H](2-)@5.96CL 70:5ME223480--5.96712.4861
CL 70:6; [M-2H](2-)@9.10CL 70:6ME223481--9.1711.4783
CL 70:7; [M-2H](2-)@8.87CL 70:7ME223482--8.87710.4705
CL 72:1; [M-2H](2-)@7.15CL 72:1ME223483--7.15730.5331
CL 72:3; [M-2H](2-)@6.76CL 72:3ME223484--6.76728.5174
CL 72:5; [M-2H](2-)@6.23CL 72:5ME223485--6.23726.5018
CL 72:5; [M-2H](2-)@9.51CL 72:5ME223486--9.51726.5018
CL 72:6; [M-2H](2-)@9.35CL 72:6ME223487--9.35725.4939
CL 72:7; [M-2H](2-)@9.15CL 72:7ME223488--9.15724.4861
CL 72:8; [M-2H](2-)@8.94CL 72:8ME223489--8.94723.4783
CL 72:9; [M-2H](2-)@8.79CL 72:9ME223490--8.79722.4705
CL 74:1; [M-2H](2-)@6.67CL 74:1ME223491--6.67744.5487
CL 74:1; [M-2H](2-)@6.72CL 74:1ME223492--6.72744.5487
CL 74:5; [M-2H](2-)@5.99CL 74:5ME223493--5.99740.5174
CL 74:7; [M-2H](2-)@6.10CL 74:7ME223494--6.1738.5018
CL 74:8; [M-2H](2-)@9.20CL 74:8ME223495--9.2737.4939
CL 74:9; [M-2H](2-)@9.04CL 74:9ME223496--9.04736.4861
CL 76:3; [M-2H](2-)@7.33CL 76:3ME223497--7.33756.5487
CL 76:5; [M-2H](2-)@6.92CL 76:5ME223498--6.92754.5331
CL 76:7; [M-2H](2-)@6.70CL 76:7ME223499--6.7752.5174
CL 78:3; [M-2H](2-)@6.10CL 78:3ME223500--6.1770.5644
CL 78:5; [M-2H](2-)@6.38CL 78:5ME223501--6.38768.5487
CL 78:5; [M-2H](2-)@6.42CL 78:5ME223502--6.42768.5487
CL 82:13; [M-2H](2-)@6.29CL 82:13ME223503--6.29788.5174
CL 82:9; [M-2H](2-)@7.08CL 82:9ME223504--7.08792.5487
FFA(16:0)Palmitic acidME223516--2.18255.2329
FFA(18:0)Stearic acidME2235175281-3.13283.2642
FFA(18:1)Octadecenoic acidME223518--2.4281.2486
FFA(18:2)Octadecadienoic acidME223519--1.84279.2329
FFA(20:0)Arachidic acidME22352010467-4.17311.2955
FFA(20:1)Heneicosenoic acidME223521--3.3309.2799
FFA(20:2)Eicosadienoic acidME223522--2.64307.2642
FFA(22:0)Behenic acidME2235238215-5.17339.3268
FFA(22:1)Docosenoic acidME223524--4.28337.3112
FFA(22:2)Docosadienoic acidME223525--3.59335.2955
FFA(22:3)Docosatrienoic acidME223526--2.99333.2799
FFA(24:0)Lignoceric acidME22352711197-6.07367.3581
FFA(24:1)Tetracosenoic acidME223528--5.22365.3425
FFA(24:2)Tetracosadienoic acidME223529--4.57363.3268
FFA(24:3)Tetracosatrienoic acidME22353052921854-3.99361.3112
lysoPE 16:0; [M-H]-@1.66LPE 16:0ME223731--1.66452.2777
lysoPE 16:1; [M-H]-@1.20LPE 16:1ME223732--1.2450.2621
lysoPE 18:0; [M-H]-@2.44LPE 18:0ME223733--2.44480.309
lysoPE 18:1; [M-H]-@1.75LPE 18:1ME223734--1.75478.2934
lysoPE 20:3; [M-H]-@1.61LPE 20:3ME223735--1.61502.2934
lysoPE 20:3; [M-H]-@1.64LPE 20:3ME223736--1.64502.2934
lysoPE 22:4; [M-H]-@1.86LPE 22:4ME223737--1.86528.309
lysoPE 22:5; [M-H]-@1.72LPE 22:5ME223738--1.72526.2934
lysoPE 22:6; [M-H]-@1.29LPE 22:6ME223739--1.29524.2777
PA 34:1; [M-H]-@6.70PA 34:1ME223531--6.7673.4808
PA 34:2; [M-H]-@6.21PA 34:2ME223532--6.21671.4652
PA 34:2; [M-H]-@6.26PA 34:2ME223533--6.26671.4652
PA 35:1; [M-H]-@6.16PA 35:1ME223534--6.16687.4965
PA 36:2; [M-H]-@6.86PA 36:2ME223535--6.86699.4965
PA 36:3; [M-H]-@6.18PA 36:3ME223536--6.18697.4808
PA 36:3; [M-H]-@6.24PA 36:3ME223537--6.24697.4808
PA 36:4; [M-H]-@6.23PA 36:4ME223538--6.23695.4652
PA 37:2; [M-H]-@6.37PA 37:2ME223539--6.37713.5121
PA 38:5; [M-H]-@5.95PA 38:5ME223540--5.95721.4808
PA 38:6; [M-H]-@6.09PA 38:6ME223541--6.09719.4652
PA 38:6; [M-H]-@6.12PA 38:6ME223542--6.12719.4652
PC 19:2; [M-Ac-H]-@1.32PC 19:2ME223543--1.32606.3407
PC 26:0; [M-Ac-H]-@4.59PC 26:0ME223544--4.59708.4816
PC 28:0; [M-Ac-H]-@5.21PC 28:0ME223545--5.21736.5129
PC 28:0; [M-Ac-H]-@5.26PC 28:0ME223546--5.26736.5129
PC 29:0; [M-Ac-H]-@5.54PC 29:0ME223547--5.54750.5285
PC 30:1; [M-Ac-H]-@5.44PC 30:1ME223548--5.44762.5285
PC 30:2; [M-Ac-H]-@4.87PC 30:2ME223549--4.87760.5129
PC 31:0; [M-Ac-H]-@6.18PC 31:0ME223550--6.18778.5598
PC 31:1; [M-Ac-H]-@5.76PC 31:1ME223551--5.76776.5442
PC 32:0; [M-Ac-H]-@6.62PC 32:0ME223552--6.62792.5754
PC 32:1; [M-Ac-H]-@6.05PC 32:1ME223553--6.05790.5598
PC 32:1; [M-Ac-H]-@6.10PC 32:1ME223554--6.1790.5598
PC 32:2; [M-Ac-H]-@5.54PC 32:2ME223555--5.54788.5442
PC 32:2; [M-Ac-H]-@5.61PC 32:2ME223556--5.61788.5442
PC 33:0; [M-Ac-H]-@6.84PC 33:0ME223557--6.84806.5911
PC 33:1; [M-Ac-H]-@6.43PC 33:1ME223558--6.43804.5754
PC 33:2; [M-Ac-H]-@5.96PC 33:2ME223559--5.96802.5598
PC 33:3; [M-Ac-H]-@5.51PC 33:3ME223560--5.51800.5442
PC 34:1; [M-Ac-H]-@6.67PC 34:1ME223561--6.67818.5911
PC 34:2; [M-Ac-H]-@6.19PC 34:2ME223562--6.19816.5754
PC 34:3; [M-Ac-H]-@5.80PC 34:3ME223563--5.8814.5598
PC 34:4; [M-Ac-H]-@5.55PC 34:4ME223564--5.55812.5442
PC 35:1; [M-Ac-H]-@6.95PC 35:1ME223565--6.95832.6068
PC 35:1; [M-Ac-H]-@7.04PC 35:1ME223566--7.04832.6068
PC 35:2; [M-Ac-H]-@6.53PC 35:2ME223567--6.53830.5911
PC 36:0; [M-Ac-H]-@7.72PC 36:0ME223568--7.72848.6381
PC 36:1; [M-Ac-H]-@7.30PC 36:1ME223569--7.3846.6224
PC 36:2; [M-Ac-H]-@6.85PC 36:2ME223570--6.85844.6068
PC 36:3; [M-Ac-H]-@6.32PC 36:3ME223571--6.32842.5911
PC 36:3; [M-Ac-H]-@6.40PC 36:3ME223572--6.4842.5911
PC 36:5; [M-Ac-H]-@5.69PC 36:5ME223573--5.69838.5598
PC 37:2; [M-Ac-H]-@7.10PC 37:2ME223574--7.1858.6224
PC 37:2; [M-Ac-H]-@7.23PC 37:2ME223575--7.23858.6224
PC 37:3; [M-Ac-H]-@6.70PC 37:3ME223576--6.7856.6068
PC 37:3; [M-Ac-H]-@6.74PC 37:3ME223577--6.74856.6068
PC 37:4; [M-Ac-H]-@6.49PC 37:4ME223578--6.49854.5911
PC 37:4; [M-Ac-H]-@6.52PC 37:4ME223579--6.52854.5911
PC 37:5; [M-Ac-H]-@5.98PC 37:5ME223580--5.98852.5754
PC 37:5; [M-Ac-H]-@6.06PC 37:5ME223581--6.06852.5754
PC 37:6; [M-Ac-H]-@5.79PC 37:6ME223582--5.79850.5598
PC 38:1; [M-Ac-H]-@7.71PC 38:1ME223583--7.71874.6537
PC 38:2; [M-Ac-H]-@7.47PC 38:2ME223584--7.47872.6381
PC 38:3; [M-Ac-H]-@7.09PC 38:3ME223585--7.09870.6224
PC 38:4; [M-Ac-H]-@6.75PC 38:4ME223586--6.75868.6068
PC 38:5; [M-Ac-H]-@6.37PC 38:5ME223587--6.37866.5911
PC 38:6; [M-Ac-H]-@6.02PC 38:6ME223588--6.02864.5754
PC 38:7; [M-Ac-H]-@5.51PC 38:7ME223589--5.51862.5598
PC 38:7; [M-Ac-H]-@5.58PC 38:7ME223590--5.58862.5598
PC 39:3; [M-Ac-H]-@7.33PC 39:3ME223591--7.33884.6381
PC 39:5; [M-Ac-H]-@6.51PC 39:5ME223592--6.51880.6068
PC 39:6; [M-Ac-H]-@6.36PC 39:6ME223593--6.36878.5911
PC 40:2; [M-Ac-H]-@7.83PC 40:2ME223594--7.83900.6694
PC 40:3; [M-Ac-H]-@7.60PC 40:3ME223595--7.6898.6537
PC 40:4; [M-Ac-H]-@7.32PC 40:4ME223596--7.32896.6381
PC 40:5; [M-Ac-H]-@7.06PC 40:5ME223597--7.06894.6224
PC 40:6; [M-Ac-H]-@6.65PC 40:6ME223598--6.65892.6068
PC 40:7; [M-Ac-H]-@6.08PC 40:7ME223599--6.08890.5911
PC 40:7; [M-Ac-H]-@6.27PC 40:7ME223600--6.27890.5911
PC 40:8; [M-Ac-H]-@5.79PC 40:8ME223601--5.79888.5754
PC 42:10; [M-Ac-H]-@5.68PC 42:10ME223602--5.68912.5754
PC 42:9; [M-Ac-H]-@5.90PC 42:9ME223603--5.9914.5911
PC 44:4; [M-Ac-H]-@8.42PC 44:4ME223604--8.42952.7007
PC 44:5; [M-Ac-H]-@8.09PC 44:5ME223605--8.09950.685
PE 30:0; [M-H]-@6.08PE 30:0ME223606--6.08662.4761
PE 30:0; [M-H]-@6.09PE 30:0ME223607--6.09662.4761
PE 32:0; [M-H]-@6.68PE 32:0ME223608--6.68690.5074
PE 32:0; [M-H]-@6.73PE 32:0ME223609--6.73690.5074
PE 32:1; [M-H]-@6.21PE 32:1ME223610--6.21688.4917
PE 32:1; [M-H]-@6.23PE 32:1ME223611--6.23688.4917
PE 32:2; [M-H]-@5.74PE 32:2ME223612--5.74686.4761
PE 33:0; [M-H]-@7.03PE 33:0ME223613--7.03704.5231
PE 33:1; [M-H]-@6.55PE 33:1ME223614--6.55702.5074
PE 33:2; [M-H]-@6.08PE 33:2ME223615--6.08700.4917
PE 33:2; [M-H]-@6.09PE 33:2ME223616--6.09700.4917
PE 34:0; [M-H]-@6.53PE 34:0ME223617--6.53718.5387
PE 34:0; [M-H]-@6.63PE 34:0ME223618--6.63718.5387
PE 34:1; [M-H]-@6.85PE 34:1ME223619--6.85716.5231
PE 34:2; [M-H]-@6.41PE 34:2ME223620--6.41714.5074
PE 34:3; [M-H]-@5.98PE 34:3ME223621--5.98712.4917
PE 34:3; [M-H]-@6.03PE 34:3ME223622--6.03712.4917
PE 34:4; [M-H]-@5.70PE 34:4ME223623--5.7710.4761
PE 34:4; [M-H]-@5.72PE 34:4ME223624--5.72710.4761
PE 35:0; [M-H]-@7.56PE 35:0ME223625--7.56732.5543
PE 35:1; [M-H]-@7.12PE 35:1ME223626--7.12730.5387
PE 35:2; [M-H]-@6.69PE 35:2ME223627--6.69728.5231
PE 35:3; [M-H]-@6.22PE 35:3ME223628--6.22726.5074
PE 35:3; [M-H]-@6.23PE 35:3ME223629--6.23726.5074
PE 35:4; [M-H]-@6.06PE 35:4ME223630--6.06724.4917
PE 35:4; [M-H]-@6.07PE 35:4ME223631--6.07724.4917
PE 36:0; [M-H]-@7.26PE 36:0ME223632--7.26746.57
PE 36:1; [M-H]-@7.43PE 36:1ME223633--7.43744.5543
PE 36:2; [M-H]-@6.97PE 36:2ME223634--6.97742.5387
PE 36:3; [M-H]-@6.52PE 36:3ME223635--6.52740.5231
PE 36:3; [M-H]-@6.54PE 36:3ME223636--6.54740.5231
PE 36:4; [M-H]-@6.24PE 36:4ME223637--6.24738.5074
PE 36:5; [M-H]-@5.95PE 36:5ME223638--5.95736.4917
PE 36:5; [M-H]-@6.01PE 36:5ME223639--6.01736.4917
PE 37:2; [M-H]-@6.62PE 37:2ME223640--6.62756.5543
PE 37:2; [M-H]-@7.16PE 37:2ME223641--7.16756.5543
PE 37:3; [M-H]-@6.89PE 37:3ME223642--6.89754.5387
PE 37:4; [M-H]-@6.66PE 37:4ME223643--6.66752.5231
PE 37:5; [M-H]-@5.71PE 37:5ME223644--5.71750.5074
PE 37:6; [M-H]-@5.96PE 37:6ME223645--5.96748.4917
PE 38:1; [M-H]-@7.33PE 38:1ME223646--7.33772.5856
PE 38:1; [M-H]-@7.89PE 38:1ME223647--7.89772.5856
PE 38:2; [M-H]-@6.83PE 38:2ME223648--6.83770.57
PE 38:2; [M-H]-@6.89PE 38:2ME223649--6.89770.57
PE 38:3; [M-H]-@7.22PE 38:3ME223650--7.22768.5543
PE 38:3; [M-H]-@7.23PE 38:3ME223651--7.23768.5543
PE 38:4; [M-H]-@7.00PE 38:4ME223652--7766.5387
PE 38:5; [M-H]-@5.72PE 38:5ME223653--5.72764.5231
PE 38:5; [M-H]-@6.49PE 38:5ME223654--6.49764.5231
PE 38:5; [M-H]-@6.50PE 38:5ME223655--6.5764.5231
PE 38:6; [M-H]-@6.07PE 38:6ME223656--6.07762.5074
PE 38:6; [M-H]-@6.17PE 38:6ME223657--6.17762.5074
PE 38:7; [M-H]-@5.76PE 38:7ME223658--5.76760.4917
PE 39:4; [M-H]-@7.12PE 39:4ME223659--7.12780.5543
PE 40:2; [M-H]-@7.47PE 40:2ME223660--7.47798.6013
PE 40:2; [M-H]-@8.09PE 40:2ME223661--8.09798.6013
PE 40:3; [M-H]-@7.05PE 40:3ME223662--7.05796.5856
PE 40:3; [M-H]-@7.12PE 40:3ME223663--7.12796.5856
PE 40:4; [M-H]-@6.88PE 40:4ME223664--6.88794.57
PE 40:4; [M-H]-@7.42PE 40:4ME223665--7.42794.57
PE 40:5; [M-H]-@6.32PE 40:5ME223666--6.32792.5543
PE 40:5; [M-H]-@7.13PE 40:5ME223667--7.13792.5543
PE 40:6; [M-H]-@6.91PE 40:6ME223668--6.91790.5387
PE 40:7; [M-H]-@6.36PE 40:7ME223669--6.36788.5231
PE 40:7; [M-H]-@6.41PE 40:7ME223670--6.41788.5231
PE 40:8; [M-H]-@5.85PE 40:8ME223671--5.85786.5074
PE 40:8; [M-H]-@5.96PE 40:8ME223672--5.96786.5074
PE 42:1; [M-H]-@8.83PE 42:1ME223673--8.83828.6483
PE 42:2; [M-H]-@8.55PE 42:2ME223674--8.55826.6326
PE 42:4; [M-H]-@8.06PE 42:4ME223675--8.06822.6013
PE 44:4; [M-H]-@8.52PE 44:4ME223676--8.52850.6326
PG 32:0; [M-H]-@5.74PG 32:0ME223677--5.74721.5019
PG 32:0; [M-H]-@5.80PG 32:0ME223678--5.8721.5019
PG 33:0; [M-H]-@6.07PG 33:0ME223679--6.07735.5176
PG 33:0; [M-H]-@6.09PG 33:0ME223680--6.09735.5176
PG 34:1; [M-H]-@5.84PG 34:1ME223681--5.84747.5176
PG 34:2; [M-H]-@5.45PG 34:2ME223682--5.45745.5019
PG 34:2; [M-H]-@5.46PG 34:2ME223683--5.46745.5019
PG 35:1; [M-H]-@6.13PG 35:1ME223684--6.13761.5333
PG 36:0; [M-H]-@6.87PG 36:0ME223685--6.87777.5646
PG 36:0; [M-H]-@6.93PG 36:0ME223686--6.93777.5646
PG 36:2; [M-H]-@6.08PG 36:2ME223687--6.08773.5333
PG 36:2; [M-H]-@6.13PG 36:2ME223688--6.13773.5333
PG 36:3; [M-H]-@5.30PG 36:3ME223689--5.3771.5176
PG 36:4; [M-H]-@4.95PG 36:4ME223690--4.95769.5019
PG 38:4; [M-H]-@6.06PG 38:4ME223691--6.06797.5333
PG 38:5; [M-H]-@5.50PG 38:5ME223692--5.5795.5176
PI 32:1; [M-H]-@5.04PI 32:1ME223693--5.04807.5024
PI 34:1; [M-H]-@5.70PI 34:1ME223694--5.7835.5337
PI 34:1; [M-H]-@5.71PI 34:1ME223695--5.71835.5337
PI 34:2; [M-H]-@5.26PI 34:2ME223696--5.26833.518
PI 34:2; [M-H]-@5.30PI 34:2ME223697--5.3833.518
PI 35:2; [M-H]-@5.59PI 35:2ME223698--5.59847.5337
PI 36:1; [M-H]-@6.30PI 36:1ME223699--6.3863.5649
PI 36:1; [M-H]-@6.32PI 36:1ME223700--6.32863.5649
PI 36:2; [M-H]-@5.88PI 36:2ME223701--5.88861.5493
PI 36:2; [M-H]-@5.92PI 36:2ME223702--5.92861.5493
PI 36:3; [M-H]-@5.43PI 36:3ME223703--5.43859.5337
PI 36:4; [M-H]-@5.24PI 36:4ME223704--5.24857.518
PI 36:4; [M-H]-@5.26PI 36:4ME223705--5.26857.518
PI 38:3; [M-H]-@6.07PI 38:3ME223706--6.07887.5649
PI 38:3; [M-H]-@6.10PI 38:3ME223707--6.1887.5649
PI 38:4; [M-H]-@5.86PI 38:4ME223708--5.86885.5493
PI 38:4; [M-H]-@5.87PI 38:4ME223709--5.87885.5493
PI 38:5; [M-H]-@5.35PI 38:5ME223710--5.35883.5337
PI 38:5; [M-H]-@5.43PI 38:5ME223711--5.43883.5337
PI 38:6; [M-H]-@5.13PI 38:6ME223712--5.13881.518
PI 40:4; [M-H]-@6.33PI 40:4ME223713--6.33913.5806
PI 40:5; [M-H]-@6.01PI 40:5ME223714--6.01911.5649
PI 40:5; [M-H]-@6.15PI 40:5ME223715--6.15911.5649
PI 40:6; [M-H]-@5.80PI 40:6ME223716--5.8909.5493
PI 40:6; [M-H]-@5.84PI 40:6ME223717--5.84909.5493
plasmenyl-PE 28:0; [M-H]-@5.79PE P-28:0ME223740--5.79618.4499
plasmenyl-PE 30:0; [M-H]-@6.45PE P-30:0ME223741--6.45646.4812
plasmenyl-PE 32:0; [M-H]-@7.07PE P-32:0ME223742--7.07674.5124
plasmenyl-PE 32:1; [M-H]-@6.58PE P-32:1ME223743--6.58672.4968
plasmenyl-PE 33:0; [M-H]-@7.21PE P-33:0ME223744--7.21688.5281
plasmenyl-PE 34:0; [M-H]-@7.22PE P-34:0ME223745--7.22702.5438
plasmenyl-PE 34:0; [M-H]-@7.61PE P-34:0ME223746--7.61702.5438
plasmenyl-PE 34:1; [M-H]-@7.19PE P-34:1ME223747--7.19700.5281
plasmenyl-PE 34:2; [M-H]-@6.67PE P-34:2ME223748--6.67698.5124
plasmenyl-PE 34:3; [M-H]-@6.31PE P-34:3ME223749--6.31696.4968
plasmenyl-PE 34:3; [M-H]-@6.37PE P-34:3ME223750--6.37696.4968
plasmenyl-PE 35:1; [M-H]-@7.45PE P-35:1ME223751--7.45714.5438
plasmenyl-PE 36:0; [M-H]-@7.71PE P-36:0ME223752--7.71730.5751
plasmenyl-PE 36:0; [M-H]-@8.10PE P-36:0ME223753--8.1730.5751
plasmenyl-PE 36:1; [M-H]-@7.73PE P-36:1ME223754--7.73728.5594
plasmenyl-PE 36:2; [M-H]-@7.29PE P-36:2ME223755--7.29726.5438
plasmenyl-PE 36:2; [M-H]-@7.31PE P-36:2ME223756--7.31726.5438
plasmenyl-PE 36:3; [M-H]-@6.90PE P-36:3ME223757--6.9724.5281
plasmenyl-PE 36:3; [M-H]-@6.91PE P-36:3ME223758--6.91724.5281
plasmenyl-PE 36:4; [M-H]-@6.65PE P-36:4ME223759--6.65722.5124
plasmenyl-PE 36:5; [M-H]-@6.32PE P-36:5ME223760--6.32720.4968
plasmenyl-PE 38:1; [M-H]-@8.24PE P-38:1ME223761--8.24756.5907
plasmenyl-PE 38:2; [M-H]-@7.88PE P-38:2ME223762--7.88754.5751
plasmenyl-PE 38:3; [M-H]-@7.50PE P-38:3ME223763--7.5752.5594
plasmenyl-PE 38:4; [M-H]-@7.19PE P-38:4ME223764--7.19750.5438
plasmenyl-PE 38:5; [M-H]-@6.75PE P-38:5ME223765--6.75748.5281
plasmenyl-PE 38:6; [M-H]-@6.54PE P-38:6ME223766--6.54746.5124
plasmenyl-PE 38:6; [M-H]-@6.56PE P-38:6ME223767--6.56746.5124
plasmenyl-PE 40:3; [M-H]-@8.07PE P-40:3ME223768--8.07780.5907
plasmenyl-PE 40:4; [M-H]-@7.76PE P-40:4ME223769--7.76778.5751
plasmenyl-PE 40:5; [M-H]-@7.42PE P-40:5ME223770--7.42776.5594
plasmenyl-PE 40:6; [M-H]-@7.17PE P-40:6ME223771--7.17774.5438
plasmenyl-PE 40:6; [M-H]-@7.20PE P-40:6ME223772--7.2774.5438
plasmenyl-PE 42:4; [M-H]-@8.03PE P-42:4ME223773--8.03806.6064
plasmenyl-PE 42:5; [M-H]-@7.86PE P-42:5ME223774--7.86804.5907
plasmenyl-PE 42:5; [M-H]-@7.88PE P-42:5ME223775--7.88804.5907
plasmenyl-PE 42:6; [M-H]-@7.73PE P-42:6ME223776--7.73802.5751
plasmenyl-PE 42:6; [M-H]-@7.76PE P-42:6ME223777--7.76802.5751
PS 34:2; [M-H]-@5.36PS 34:2ME223718--5.36758.4972
PS 36:1; [M-H]-@6.43PS 36:1ME223719--6.43788.5442
PS 36:2; [M-H]-@6.01PS 36:2ME223720--6.01786.5285
PS 36:3; [M-H]-@5.54PS 36:3ME223721--5.54784.5129
PS 38:3; [M-H]-@6.22PS 38:3ME223722--6.22812.5442
PS 38:4; [M-H]-@5.97PS 38:4ME223723--5.97810.5285
PS 38:4; [M-H]-@6.01PS 38:4ME223724--6.01810.5285
PS 38:5; [M-H]-@5.57PS 38:5ME223725--5.57808.5129
PS 40:4; [M-H]-@6.43PS 40:4ME223726--6.43838.5598
PS 40:5; [M-H]-@6.12PS 40:5ME223727--6.12836.5442
PS 40:6; [M-H]-@5.88PS 40:6ME223728--5.88834.5285
PS 40:7; [M-H]-@5.45PS 40:7ME223729--5.45832.5129
PS 40:8; [M-H]-@4.98PS 40:8ME223730--4.98830.4972


Analysis: C18 POSITIVE ION MODE/Triple TOF

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
CE(16:0); [M+NH4]+@10.98CE 16:0ME223778246520-10.98642.6189
CE(16:0); [M+NH4]+@11.03CE 16:0ME223779246520-11.03642.6189
CE(16:1); [M+NH4]+@10.68CE 16:1ME223780--10.68640.6032
CE(17:1); [M+NH4]+@10.87CE 17:1ME22378124779603-10.87654.6189
CE(17:1); [M+NH4]+@10.93CE 17:1ME22378224779603-10.93654.6189
CE(18:0); [M+NH4]+@11.37CE 18:0ME223783118246-11.37670.6502
CE(18:0); [M+NH4]+@11.42CE 18:0ME223784118246-11.42670.6502
CE(18:1); [M+NH4]+@10.91CE 18:1ME2237855283632-10.91668.6345
CE(18:1); [M+NH4]+@11.05CE 18:1ME2237865283632-11.05668.6345
CE(18:2); [M+NH4]+@10.70CE 18:2ME2237875287939-10.7666.6189
CE(18:2); [M+NH4]+@10.79CE 18:2ME2237885287939-10.79666.6189
CE(18:3); [M+NH4]+@10.51CE 18:3ME2237896436907-10.51664.6032
CE(18:3); [M+NH4]+@10.54CE 18:3ME2237906436907-10.54664.6032
CE(18:3); [M+NH4]+@9.22CE 18:3ME2237916436907-9.22664.6032
CE(20:1); [M+NH4]+@11.29CE 20:1ME22379216061337-11.29696.6659
CE(20:2); [M+NH4]+@11.07CE 20:2ME22379316061338-11.07694.6502
CE(20:3); [M+NH4]+@10.77CE 20:3ME22379414274976-10.77692.6345
CE(20:3); [M+NH4]+@10.82CE 20:3ME22379514274976-10.82692.6345
CE(20:4); [M+NH4]+@10.58CE 20:4ME2237966479222-10.58690.6189
CE(20:4); [M+NH4]+@10.65CE 20:4ME2237976479222-10.65690.6189
CE(20:5); [M+NH4]+@10.41CE 20:5ME22379810372299-10.41688.6032
CE(20:5); [M+NH4]+@10.45CE 20:5ME22379910372299-10.45688.6032
CE(20:5); [M+NH4]+@9.20CE 20:5ME22380010372299-9.2688.6032
CE(22:4); [M+NH4]+@10.88CE 22:4ME22380116061341-10.88718.6502
CE(22:4); [M+NH4]+@10.93CE 22:4ME22380216061341-10.93718.6502
CE(22:5); [M+NH4]+@10.71CE 22:5ME22380342608400-10.71716.6345
CE(22:5); [M+NH4]+@10.75CE 22:5ME22380442608400-10.75716.6345
CE(22:6); [M+NH4]+@10.49CE 22:6ME22380514274978-10.49714.6189
CE(22:6); [M+NH4]+@10.54CE 22:6ME22380614274978-10.54714.6189
DG 30:0; [M+NH4]+@7.39DG 30:0ME223807--7.39558.5094
DG 30:0; [M+NH4]+@7.40DG 30:0ME223808--7.4558.5094
DG 30:1; [M+NH4]+@6.91DG 30:1ME223809--6.91556.4938
DG 30:1; [M+NH4]+@6.93DG 30:1ME223810--6.93556.4938
DG 30:2; [M+NH4]+@6.46DG 30:2ME223811--6.46554.4782
DG 31:0; [M+NH4]+@7.58DG 31:0ME223812--7.58572.5251
DG 31:0; [M+NH4]+@7.63DG 31:0ME223813--7.63572.5251
DG 32:0; [M+NH4]+@7.89DG 32:0ME223814--7.89586.5407
DG 32:0; [M+NH4]+@7.90DG 32:0ME223815--7.9586.5407
DG 32:1; [M+NH4]+@7.48DG 32:1ME223816--7.48584.5251
DG 32:1; [M+NH4]+@7.50DG 32:1ME223817--7.5584.5251
DG 32:2; [M+NH4]+@7.06DG 32:2ME223818--7.06582.5094
DG 32:2; [M+NH4]+@7.09DG 32:2ME223819--7.09582.5094
DG 33:0; [M+NH4]+@8.09DG 33:0ME223820--8.09600.5564
DG 33:0; [M+NH4]+@8.12DG 33:0ME223821--8.12600.5564
DG 33:1; [M+NH4]+@7.67DG 33:1ME223822--7.67598.5407
DG 33:1; [M+NH4]+@7.76DG 33:1ME223823--7.76598.5407
DG 33:2; [M+NH4]+@7.19DG 33:2ME223824--7.19596.5251
DG 34:0; [M+NH4]+@8.39DG 34:0ME223825--8.39614.572
DG 34:0; [M+NH4]+@8.42DG 34:0ME223826--8.42614.572
DG 34:2; [M+NH4]+@7.56DG 34:2ME223827--7.56610.5407
DG 34:2; [M+NH4]+@7.61DG 34:2ME223828--7.61610.5407
DG 34:3; [M+NH4]+@7.17DG 34:3ME223829--7.17608.5251
DG 34:3; [M+NH4]+@7.22DG 34:3ME223830--7.22608.5251
DG 34:4; [M+NH4]+@6.90DG 34:4ME223831--6.9606.5094
DG 35:0; [M+NH4]+@8.62DG 35:0ME223832--8.62628.5877
DG 35:1; [M+NH4]+@8.21DG 35:1ME223833--8.21626.572
DG 35:1; [M+NH4]+@8.25DG 35:1ME223834--8.25626.572
DG 35:2; [M+NH4]+@7.86DG 35:2ME223835--7.86624.5564
DG 35:2; [M+NH4]+@7.87DG 35:2ME223836--7.87624.5564
DG 35:3; [M+NH4]+@7.51DG 35:3ME223837--7.51622.5407
DG 36:0; [M+NH4]+@8.87DG 36:0ME223838--8.87642.6033
DG 36:0; [M+NH4]+@8.88DG 36:0ME223839--8.88642.6033
DG 36:1; [M+NH4]+@8.46DG 36:1ME223840--8.46640.5877
DG 36:1; [M+NH4]+@8.50DG 36:1ME223841--8.5640.5877
DG 36:2; [M+NH4]+@8.03DG 36:2ME223842--8.03638.572
DG 36:2; [M+NH4]+@8.07DG 36:2ME223843--8.07638.572
DG 36:3; [M+NH4]+@7.66DG 36:3ME223844--7.66636.5564
DG 36:3; [M+NH4]+@7.71DG 36:3ME223845--7.71636.5564
DG 36:4; [M+NH4]+@7.38DG 36:4ME223846--7.38634.5407
DG 36:4; [M+NH4]+@7.40DG 36:4ME223847--7.4634.5407
DG 36:5; [M+NH4]+@6.99DG 36:5ME223848--6.99632.5251
DG 36:5; [M+NH4]+@7.01DG 36:5ME223849--7.01632.5251
DG 38:1; [M+NH4]+@8.69DG 38:1ME223850--8.69668.6189
DG 38:1; [M+NH4]+@8.95DG 38:1ME223851--8.95668.6189
DG 38:2; [M+NH4]+@8.55DG 38:2ME223852--8.55666.6033
DG 38:2; [M+NH4]+@8.58DG 38:2ME223853--8.58666.6033
DG 38:3; [M+NH4]+@8.22DG 38:3ME223854--8.22664.5877
DG 38:3; [M+NH4]+@8.35DG 38:3ME223855--8.35664.5877
DG 38:4; [M+NH4]+@7.90DG 38:4ME223856--7.9662.572
DG 38:4; [M+NH4]+@8.04DG 38:4ME223857--8.04662.572
DG 38:5; [M+NH4]+@7.61DG 38:5ME223858--7.61660.5564
DG 38:5; [M+NH4]+@7.69DG 38:5ME223859--7.69660.5564
DG 38:6; [M+NH4]+@7.27DG 38:6ME223860--7.27658.5407
DG 38:6; [M+NH4]+@7.38DG 38:6ME223861--7.38658.5407
DG 38:7; [M+NH4]+@6.93DG 38:7ME223862--6.93656.5251
DG 40:4; [M+NH4]+@8.49DG 40:4ME223863--8.49690.6033
DG 40:5; [M+NH4]+@8.06DG 40:5ME223864--8.06688.5877
DG 40:5; [M+NH4]+@8.08DG 40:5ME223865--8.08688.5877
DG 40:6; [M+NH4]+@7.72DG 40:6ME223866--7.72686.572
DG 40:6; [M+NH4]+@7.77DG 40:6ME223867--7.77686.572
DG 40:7; [M+NH4]+@7.55DG 40:7ME223868--7.55684.5564
DG 40:7; [M+NH4]+@7.60DG 40:7ME223869--7.6684.5564
DG 40:8; [M+NH4]+@7.18DG 40:8ME223870--7.18682.5407
lysoPC 14:0; [M+H]+@1.00LPC 14:0ME224211--1468.309
lysoPC 14:0; [M+H]+@1.03LPC 14:0ME224212--1.03468.309
lysoPC 15:0; [M+H]+@1.20LPC 15:0ME22421324779458-1.2482.3246
lysoPC 15:0; [M+H]+@1.24LPC 15:0ME22421424779458-1.24482.3246
lysoPC 16:0; [M+H]+@1.55LPC 16:0ME224215--1.55496.3403
lysoPC 16:0; [M+H]+@1.56LPC 16:0ME224216--1.56496.3403
lysoPC 16:1; [M+H]+@1.15LPC 16:1ME224217--1.15494.3246
lysoPC 16:1; [M+H]+@1.16LPC 16:1ME224218--1.16494.3246
lysoPC 17:1; [M+H]+@1.42LPC 17:1ME224219--1.42508.3403
lysoPC 17:1; [M+H]+@1.46LPC 17:1ME224220--1.46508.3403
lysoPC 18:0; [M+H]+@2.31LPC 18:0ME224221--2.31524.3716
lysoPC 18:0; [M+H]+@2.38LPC 18:0ME224222--2.38524.3716
lysoPC 18:1; [M+H]+@1.65LPC 18:1ME224223--1.65522.356
lysoPC 18:1; [M+H]+@1.80LPC 18:1ME224224--1.8522.356
lysoPC 18:2; [M+H]+@1.25LPC 18:2ME224225--1.25520.3403
lysoPC 18:2; [M+H]+@1.37LPC 18:2ME224226--1.37520.3403
lysoPC 18:3; [M+H]+@1.05LPC 18:3ME224227--1.05518.3246
lysoPC 18:3; [M+H]+@1.06LPC 18:3ME224228--1.06518.3246
lysoPC 19:0; [M+H]+@2.81LPC 19:0ME22422924779472-2.81538.3873
lysoPC 19:0; [M+H]+@2.83LPC 19:0ME22423024779472-2.83538.3873
lysoPC 20:0; [M+H]+@3.25LPC 20:0ME22423124779473-3.25552.4029
lysoPC 20:0; [M+H]+@3.33LPC 20:0ME22423224779473-3.33552.4029
lysoPC 20:1; [M+H]+@2.51LPC 20:1ME224233--2.51550.3873
lysoPC 20:1; [M+H]+@2.54LPC 20:1ME224234--2.54550.3873
lysoPC 20:2; [M+H]+@1.93LPC 20:2ME22423552924053-1.93548.3716
lysoPC 20:3; [M+H]+@1.43LPC 20:3ME224236--1.43546.356
lysoPC 20:3; [M+H]+@1.50LPC 20:3ME224237--1.5546.356
lysoPC 20:4; [M+H]+@1.30LPC 20:4ME224238--1.3544.3403
lysoPC 20:4; [M+H]+@1.31LPC 20:4ME224239--1.31544.3403
lysoPC 20:5; [M+H]+@1.01LPC 20:5ME22424011757087-1.01542.3246
lysoPC 20:5; [M+H]+@1.02LPC 20:5ME22424111757087-1.02542.3246
lysoPC 22:0; [M+H]+@4.21LPC 22:0ME22424224779479-4.21580.4342
lysoPC 22:0; [M+H]+@4.29LPC 22:0ME22424324779479-4.29580.4342
lysoPC 22:4; [M+H]+@1.82LPC 22:4ME22424452924039-1.82572.3716
lysoPC 22:5; [M+H]+@1.44LPC 22:5ME224245--1.44570.356
lysoPC 22:6; [M+H]+@1.18LPC 22:6ME22424610415542-1.18568.3403
lysoPC 22:6; [M+H]+@1.22LPC 22:6ME22424710415542-1.22568.3403
lysoPC 24:0; [M+H]+@5.19LPC 24:0ME22424824779481-5.19608.4655
lysoPC 24:1; [M+H]+@4.30LPC 24:1ME22424953480477-4.3606.4498
lysoPE 16:0; [M+H]+@1.68LPE 16:0ME224250--1.68454.2934
lysoPE 18:0; [M+H]+@2.48LPE 18:0ME224251--2.48482.3246
lysoPE 18:1; [M+H]+@1.82LPE 18:1ME224252--1.82480.309
lysoPE 18:2; [M+H]+@1.32LPE 18:2ME224253--1.32478.2934
lysoPE 18:3; [M+H]+@1.12LPE 18:3ME224254--1.12476.2777
lysoPE 20:4; [M+H]+@1.26LPE 20:4ME224255--1.26502.2934
lysoPE 20:4; [M+H]+@1.27LPE 20:4ME224256--1.27502.2934
lysoPE 22:5; [M+H]+@1.45LPE 22:5ME224257--1.45528.309
lysoPE 22:6; [M+H]+@1.22LPE 22:6ME224258--1.22526.2933
MG 16:0; [M+NH4]+@2.71MG 16:0ME223871--2.71348.3114
MG 17:0; [M+Li]+@3.14MG 17:0ME223872107036-3.14351.3087
MG 18:1; [M+NH4]+@2.92MG 18:1ME223873--2.92374.327
MG 18:2; [M+NH4]+@2.27MG 18:2ME2238745283469-2.27372.3114
PC 19:1; [M+H]+@1.78PC 19:1ME22387524778752-1.78550.3509
PC 20:0; [M+H]+@2.37PC 20:0ME223876--2.37566.3821
PC 21:4; [M+H]+@1.27PC 21:4ME223877--1.27572.3352
PC 28:1; [M+H]+@4.71PC 28:1ME223878--4.71676.4917
PC 30:0; [M+H]+@5.76PC 30:0ME223879--5.76706.5387
PC 30:0; [M+H]+@5.87PC 30:0ME223880--5.87706.5387
PC 30:1; [M+H]+@5.37PC 30:1ME223881--5.37704.523
PC 31:0; [M+H]+@6.13PC 31:0ME223882--6.13720.5543
PC 32:0; [M+H]+@6.48PC 32:0ME223883--6.48734.57
PC 32:2; [M+H]+@5.50PC 32:2ME223884--5.5730.5387
PC 32:3; [M+H]+@5.09PC 32:3ME223885--5.09728.523
PC 32:3; [M+H]+@5.21PC 32:3ME223886--5.21728.523
PC 33:1; [M+H]+@6.36PC 33:1ME223887--6.36746.57
PC 33:2; [M+H]+@5.85PC 33:2ME223888--5.85744.5543
PC 33:3; [M+H]+@5.62PC 33:3ME223889--5.62742.5387
PC 34:1; [M+H]+@6.61PC 34:1ME223890--6.61760.5856
PC 34:2; [M+H]+@5.12PC 34:2ME223891--5.12758.57
PC 34:2; [M+H]+@6.16PC 34:2ME223892--6.16758.57
PC 34:3; [M+H]+@5.73PC 34:3ME223893--5.73756.5543
PC 34:4; [M+H]+@5.40PC 34:4ME223894--5.4754.5387
PC 34:4; [M+H]+@6.14PC 34:4ME223895--6.14754.5387
PC 34:5; [M+H]+@5.21PC 34:5ME223896--5.21752.523
PC 35:0; [M+H]+@7.50PC 35:0ME223897--7.5776.617
PC 35:2; [M+H]+@6.45PC 35:2ME223898--6.45772.5856
PC 35:3; [M+H]+@6.01PC 35:3ME223899--6.01770.57
PC 35:3; [M+H]+@7.22PC 35:3ME223900--7.22770.57
PC 35:4; [M+H]+@5.78PC 35:4ME223901--5.78768.5543
PC 35:4; [M+H]+@5.81PC 35:4ME223902--5.81768.5543
PC 35:5; [M+H]+@5.47PC 35:5ME223903--5.47766.5387
PC 35:5; [M+H]+@5.54PC 35:5ME223904--5.54766.5387
PC 36:0; [M+H]+@7.90PC 36:0ME223905--7.9790.6326
PC 36:1; [M+H]+@7.22PC 36:1ME223906--7.22788.617
PC 36:2; [M+H]+@6.81PC 36:2ME223907--6.81786.6013
PC 36:3; [M+H]+@6.31PC 36:3ME223908--6.31784.5856
PC 36:4; [M+H]+@5.97PC 36:4ME223909--5.97782.57
PC 36:4; [M+H]+@6.18PC 36:4ME223910--6.18782.57
PC 36:5; [M+H]+@5.70PC 36:5ME223911--5.7780.5543
PC 36:6; [M+H]+@5.35PC 36:6ME223912--5.35778.5387
PC 36:6; [M+H]+@5.47PC 36:6ME223913--5.47778.5387
PC 36:7; [M+H]+@5.47PC 36:7ME223914--5.47776.523
PC 37:6; [M+H]+@5.80PC 37:6ME223915--5.8792.5543
PC 37:7; [M+H]+@5.97PC 37:7ME223916--5.97790.5387
PC 38:1; [M+H]+@7.95PC 38:1ME223917--7.95816.6482
PC 38:2; [M+H]+@7.31PC 38:2ME223918--7.31814.6326
PC 38:3; [M+H]+@7.00PC 38:3ME223919--7812.617
PC 38:4; [M+H]+@6.75PC 38:4ME223920--6.75810.6013
PC 38:5; [M+H]+@6.30PC 38:5ME223921--6.3808.5856
PC 38:6; [M+H]+@6.06PC 38:6ME223922--6.06806.57
PC 38:8; [M+H]+@5.77PC 38:8ME223923--5.77802.5387
PC 38:9; [M+H]+@5.46PC 38:9ME223924--5.46800.523
PC 39:3; [M+H]+@7.45PC 39:3ME223925--7.45826.6326
PC 39:4; [M+H]+@7.10PC 39:4ME223926--7.1824.617
PC 39:5; [M+H]+@6.35PC 39:5ME223927--6.35822.6013
PC 39:6; [M+H]+@6.23PC 39:6ME223928--6.23820.5856
PC 39:7; [M+H]+@6.03PC 39:7ME223929--6.03818.57
PC 40:10; [M+H]+@5.62PC 40:10ME223930--5.62826.5387
PC 40:1; [M+H]+@8.54PC 40:1ME223931--8.54844.6795
PC 40:2; [M+H]+@8.12PC 40:2ME223932--8.12842.6639
PC 40:4; [M+H]+@7.27PC 40:4ME223933--7.27838.6326
PC 40:5; [M+H]+@6.82PC 40:5ME223934--6.82836.617
PC 40:6; [M+H]+@6.65PC 40:6ME223935--6.65834.6013
PC 40:8; [M+H]+@5.75PC 40:8ME223936--5.75830.57
PC 40:9; [M+H]+@5.43PC 40:9ME223937--5.43828.5543
PC 41:4; [M+H]+@7.72PC 41:4ME223938--7.72852.6482
PC 42:10; [M+H]+@5.72PC 42:10ME223939--5.72854.57
PC 42:11; [M+H]+@5.75PC 42:11ME223940--5.75852.5543
PC 42:2; [M+H]+@8.76PC 42:2ME223941--8.76870.6952
PC 42:4; [M+H]+@8.05PC 42:4ME223942--8.05866.6639
PC 42:5; [M+H]+@7.46PC 42:5ME223943--7.46864.6482
PC 42:5; [M+H]+@7.57PC 42:5ME223944--7.57864.6482
PC 42:6; [M+H]+@7.24PC 42:6ME223945--7.24862.6326
PC 42:7; [M+H]+@6.90PC 42:7ME223946--6.9860.617
PC 42:8; [M+H]+@7.23PC 42:8ME223947--7.23858.6013
PC 42:9; [M+H]+@6.02PC 42:9ME223948--6.02856.5856
PC 44:4; [M+H]+@8.68PC 44:4ME223949--8.68894.6952
PE 19:2; [M+H]+@1.39PE 19:2ME223950--1.39506.2883
PE 21:4; [M+H]+@1.33PE 21:4ME223951--1.33530.2883
PE 23:4; [M+H]+@1.89PE 23:4ME223952--1.89558.3196
PE 32:2; [M+H]+@5.73PE 32:2ME223953--5.73688.4917
PE 34:1; [M+H]+@6.81PE 34:1ME223954--6.81718.5387
PE 34:2; [M+H]+@6.38PE 34:2ME223955--6.38716.523
PE 35:2; [M+H]+@6.68PE 35:2ME223956--6.68730.5387
PE 36:0; [M+H]+@7.82PE 36:0ME223957--7.82748.5856
PE 36:1; [M+H]+@7.39PE 36:1ME223958--7.39746.57
PE 36:2; [M+H]+@6.96PE 36:2ME223959--6.96744.5543
PE 36:2; [M+H]+@7.03PE 36:2ME223960--7.03744.5543
PE 36:4; [M+H]+@6.35PE 36:4ME223961--6.35740.523
PE 36:6; [M+H]+@5.61PE 36:6ME223962--5.61736.4917
PE 37:4; [M+H]+@6.64PE 37:4ME223963--6.64754.5387
PE 38:4; [M+H]+@6.98PE 38:4ME223964--6.98768.5543
PE 40:1; [M+H]+@8.37PE 40:1ME223965--8.37802.6326
PE 40:4; [M+H]+@7.38PE 40:4ME223966--7.38796.5856
PE 40:5; [M+H]+@7.24PE 40:5ME223967--7.24794.57
PE 40:6; [M+H]+@6.88PE 40:6ME223968--6.88792.5543
plasmenyl-PC 18:0; [M+Na]+@1.79PC P-18:0ME224259--1.79544.3379
plasmenyl-PC 34:1; [M+Na]+@7.12PC P-34:1ME224260--7.12766.5727
plasmenyl-PC 36:3; [M+Na]+@6.70PC P-36:3ME224261--6.7790.5727
plasmenyl-PC 38:0; [M+Na]+@7.96PC P-38:0ME224262--7.96824.6509
plasmenyl-PC 38:3; [M+Na]+@7.13PC P-38:3ME224263--7.13818.604
plasmenyl-PC 40:3; [M+Na]+@7.80PC P-40:3ME224264--7.8846.6353
plasmenyl-PC 42:4; [M+Na]+@8.03PC P-42:4ME224265--8.03872.6509
plasmenyl-PC 44:4; [M+Na]+@8.50PC P-44:4ME224266--8.5900.6822
plasmenyl-PE 32:1; [M+H]+@6.57PE P-32:1ME224267--6.57674.5125
plasmenyl-PE 34:1; [M+H]+@7.11PE P-34:1ME224268--7.11702.5438
plasmenyl-PE 34:2; [M+H]+@6.67PE P-34:2ME224269--6.67700.5281
plasmenyl-PE 34:2; [M+H]+@6.73PE P-34:2ME224270--6.73700.5281
plasmenyl-PE 36:1; [M+H]+@7.68PE P-36:1ME224271--7.68730.5751
plasmenyl-PE 36:2; [M+H]+@7.26PE P-36:2ME224272--7.26728.5594
plasmenyl-PE 36:2; [M+H]+@7.33PE P-36:2ME224273--7.33728.5594
plasmenyl-PE 36:4; [M+H]+@6.63PE P-36:4ME224274--6.63724.5281
plasmenyl-PE 36:5; [M+H]+@6.30PE P-36:5ME224275--6.3722.5125
plasmenyl-PE 38:1; [M+H]+@8.18PE P-38:1ME224276--8.18758.6063
plasmenyl-PE 38:2; [M+H]+@7.82PE P-38:2ME224277--7.82756.5907
plasmenyl-PE 38:3; [M+H]+@7.49PE P-38:3ME224278--7.49754.5751
plasmenyl-PE 38:4; [M+H]+@7.25PE P-38:4ME224279--7.25752.5594
plasmenyl-PE 40:4; [M+H]+@7.67PE P-40:4ME224280--7.67780.5907
SM 28:1; [M]+@3.57SM 18:1;O2/28:1ME223969--3.57619.4815
SM 30:0; [M]+@4.63SM 30:0;O2ME22397046891775-4.63649.5284
SM 30:1; [M]+@4.29SM 30:1;O2ME223971--4.29647.5128
SM 30:1; [M]+@4.33SM 30:1;O2ME223972--4.33647.5128
SM 31:1; [M]+@4.72SM 31:1;O2ME223973--4.72661.5284
SM 31:1; [M]+@4.74SM 31:1;O2ME223974--4.74661.5284
SM 32:0; [M]+@5.42SM 32:0;O2ME22397544260138-5.42677.5597
SM 32:1; [M]+@5.04SM 32:1;O2ME22397611433862-5.04675.5441
SM 32:1; [M]+@5.08SM 32:1;O2ME22397711433862-5.08675.5441
SM 32:2; [M]+@4.48SM 32:2;O2ME223978--4.48673.5284
SM 33:0; [M]+@5.73SM 33:0;O2ME223979--5.73691.5754
SM 33:0; [M]+@5.79SM 33:0;O2ME223980--5.79691.5754
SM 33:1; [M]+@5.34SM 33:1;O2ME22398252931139-5.34689.5597
SM 33:1; [M]+@5.44SM 33:1;O2ME22398352931139-5.44689.5597
SM 33:1; [M+Na]+@5.47SM 33:1;O2ME22398152931139-5.47711.5417
SM 33:2; [M]+@4.94SM 33:2;O2ME223984--4.94687.5441
SM 33:2; [M]+@4.96SM 33:2;O2ME223985--4.96687.5441
SM 34:0; [M]+@6.04SM 34:0;O2ME2239869939965-6.04705.5911
SM 34:1; [M]+@5.75SM 34:1;O2ME223987--5.75703.5754
SM 34:1; [M]+@5.81SM 34:1;O2ME223988--5.81703.5754
SM 34:2; [M]+@5.23SM 34:2;O2ME223989--5.23701.5597
SM 34:2; [M]+@5.27SM 34:2;O2ME223990--5.27701.5597
SM 35:0; [M]+@5.58SM 35:0;O2ME223991--5.58719.6067
SM 35:2; [M]+@5.65SM 35:2;O2ME223992--5.65715.5754
SM 36:0; [M]+@6.74SM 36:0;O2ME22399352931167-6.74733.6224
SM 36:0; [M]+@6.78SM 36:0;O2ME22399452931167-6.78733.6224
SM 36:1; [M]+@6.43SM 36:1;O2ME22399544260139-6.43731.6067
SM 36:1; [M]+@6.45SM 36:1;O2ME22399644260139-6.45731.6067
SM 36:2; [M]+@5.94SM 36:2;O2ME223997--5.94729.5911
SM 36:2; [M]+@5.97SM 36:2;O2ME223998--5.97729.5911
SM 37:0; [M]+@7.19SM 37:0;O2ME223999--7.19747.638
SM 37:1; [M]+@6.70SM 37:1;O2ME224000--6.7745.6224
SM 37:1; [M]+@6.85SM 37:1;O2ME224001--6.85745.6224
SM 37:2; [M]+@6.33SM 37:2;O2ME224002--6.33743.6067
SM 37:2; [M]+@6.43SM 37:2;O2ME224003--6.43743.6067
SM 38:0; [M]+@6.20SM 38:0;O2ME22400444260131-6.2761.6536
SM 38:0; [M]+@6.74SM 38:0;O2ME22400544260131-6.74761.6536
SM 38:1; [M]+@7.12SM 38:1;O2ME224006--7.12759.638
SM 38:1; [M]+@7.19SM 38:1;O2ME224007--7.19759.638
SM 38:2; [M]+@6.53SM 38:2;O2ME224008--6.53757.6224
SM 38:2; [M]+@6.66SM 38:2;O2ME224009--6.66757.6224
SM 38:4; [M]+@5.69SM 38:4;O2ME224010--5.69753.5911
SM 38:5; [M]+@5.24SM 38:5;O2ME224011--5.24751.5754
SM 39:1; [M]+@7.40SM 39:1;O2ME224012--7.4773.6536
SM 39:1; [M]+@7.54SM 39:1;O2ME224013--7.54773.6536
SM 39:2; [M]+@7.01SM 39:2;O2ME224014--7.01771.638
SM 39:2; [M]+@7.06SM 39:2;O2ME224015--7.06771.638
SM 40:0; [M]+@7.89SM 40:0;O2ME22401644260132-7.89789.6849
SM 40:0; [M]+@8.03SM 40:0;O2ME22401744260132-8.03789.6849
SM 40:1; [M]+@7.65SM 40:1;O2ME224018--7.65787.6693
SM 40:1; [M]+@7.73SM 40:1;O2ME224019--7.73787.6693
SM 40:2; [M]+@7.20SM 40:2;O2ME224020--7.2785.6536
SM 40:2; [M]+@7.28SM 40:2;O2ME224021--7.28785.6536
SM 40:4; [M]+@6.30SM 40:4;O2ME224022--6.3781.6224
SM 40:5; [M]+@5.93SM 40:5;O2ME224023--5.93779.6067
SM 41:1; [M]+@7.90SM 41:1;O2ME224024--7.9801.6849
SM 41:1; [M]+@8.06SM 41:1;O2ME224025--8.06801.6849
SM 41:2; [M]+@7.43SM 41:2;O2ME224026--7.43799.6693
SM 41:2; [M]+@7.62SM 41:2;O2ME224027--7.62799.6693
SM 41:4; [M]+@6.65SM 41:4;O2ME224028--6.65795.638
SM 41:5; [M]+@6.27SM 41:5;O2ME224029--6.27793.6224
SM 41:5; [M]+@6.60SM 41:5;O2ME224030--6.6793.6224
SM 42:1; [M]+@8.16SM 42:1;O2ME22403144260133-8.16815.7006
SM 42:1; [M]+@8.33SM 42:1;O2ME22403244260133-8.33815.7006
SM 42:2; [M]+@7.70SM 42:2;O2ME224033--7.7813.6849
SM 42:2; [M]+@7.78SM 42:2;O2ME224034--7.78813.6849
SM 42:4; [M]+@6.85SM 42:4;O2ME224035--6.85809.6536
SM 42:4; [M]+@6.86SM 42:4;O2ME224036--6.86809.6536
SM 42:5; [M]+@6.49SM 42:5;O2ME224037--6.49807.638
SM 42:5; [M]+@6.53SM 42:5;O2ME224038--6.53807.638
SM 43:1; [M]+@8.34SM 43:1;O2ME224039--8.34829.7163
SM 43:1; [M]+@8.54SM 43:1;O2ME224040--8.54829.7163
SM 43:2; [M]+@7.86SM 43:2;O2ME224041--7.86827.7006
SM 43:2; [M]+@7.97SM 43:2;O2ME224042--7.97827.7006
SM 43:4; [M]+@7.47SM 43:4;O2ME224043--7.47823.6693
SM 43:5; [M]+@7.42SM 43:5;O2ME224044--7.42821.6536
SM 44:1; [M]+@8.66SM 44:1;O2ME224045--8.66843.7319
SM 44:1; [M]+@8.83SM 44:1;O2ME224046--8.83843.7319
SM 44:2; [M]+@8.23SM 44:2;O2ME224047--8.23841.7163
SM 44:2; [M]+@8.33SM 44:2;O2ME224048--8.33841.7163
TG 40:0; [M+NH4]+@9.45TG 40:0ME224049--9.45712.6451
TG 40:0; [M+NH4]+@9.50TG 40:0ME224050--9.5712.6451
TG 40:1; [M+NH4]+@9.15TG 40:1ME224051--9.15710.6295
TG 42:0; [M+NH4]+@9.74TG 42:0ME224052--9.74740.6764
TG 42:0; [M+NH4]+@9.79TG 42:0ME224053--9.79740.6764
TG 42:1; [M+NH4]+@9.51TG 42:1ME224054--9.51738.6608
TG 42:1; [M+NH4]+@9.53TG 42:1ME224055--9.53738.6608
TG 42:2; [M+NH4]+@9.22TG 42:2ME224056--9.22736.6451
TG 44:1; [M+NH4]+@9.82TG 44:1ME224057--9.82766.6921
TG 44:1; [M+NH4]+@9.83TG 44:1ME224058--9.83766.6921
TG 44:2; [M+NH4]+@9.54TG 44:2ME224059--9.54764.6764
TG 44:2; [M+NH4]+@9.56TG 44:2ME224060--9.56764.6764
TG 46:0; [M+NH4]+@10.34TG 46:0ME224061--10.34796.739
TG 46:0; [M+NH4]+@10.35TG 46:0ME224062--10.35796.739
TG 46:1; [M+NH4]+@10.05TG 46:1ME224063--10.05794.7233
TG 46:1; [M+NH4]+@10.11TG 46:1ME224064--10.11794.7233
TG 46:2; [M+NH4]+@9.81TG 46:2ME224065--9.81792.7077
TG 46:2; [M+NH4]+@9.86TG 46:2ME224066--9.86792.7077
TG 46:3; [M+NH4]+@9.60TG 46:3ME224067--9.6790.6921
TG 48:0; [M+NH4]+@10.58TG 48:0ME224068--10.58824.7702
TG 48:0; [M+NH4]+@10.60TG 48:0ME224069--10.6824.7702
TG 48:1; [M+NH4]+@10.32TG 48:1ME224070--10.32822.7546
TG 48:1; [M+NH4]+@10.36TG 48:1ME224071--10.36822.7546
TG 48:2; [M+NH4]+@10.08TG 48:2ME224072--10.08820.739
TG 48:2; [M+NH4]+@10.15TG 48:2ME224073--10.15820.739
TG 48:3; [M+NH4]+@9.87TG 48:3ME224074--9.87818.7233
TG 48:3; [M+NH4]+@9.91TG 48:3ME224075--9.91818.7233
TG 49:0; [M+NH4]+@10.69TG 49:0ME224076--10.69838.7859
TG 49:0; [M+NH4]+@10.72TG 49:0ME224077--10.72838.7859
TG 49:1; [M+NH4]+@10.49TG 49:1ME224078--10.49836.7702
TG 49:1; [M+NH4]+@10.51TG 49:1ME224079--10.51836.7702
TG 49:2; [M+NH4]+@10.28TG 49:2ME224080--10.28834.7546
TG 49:2; [M+NH4]+@10.29TG 49:2ME224081--10.29834.7546
TG 49:3; [M+NH4]+@10.05TG 49:3ME224082--10.05832.739
TG 50:0; [M+NH4]+@10.82TG 50:0ME224083--10.82852.8015
TG 50:0; [M+NH4]+@10.84TG 50:0ME224084--10.84852.8015
TG 50:1; [M+NH4]+@10.57TG 50:1ME224085--10.57850.7859
TG 50:1; [M+NH4]+@10.59TG 50:1ME224086--10.59850.7859
TG 50:2; [M+NH4]+@10.35TG 50:2ME224087--10.35848.7702
TG 50:2; [M+NH4]+@10.39TG 50:2ME224088--10.39848.7702
TG 50:3; [M+NH4]+@10.12TG 50:3ME224089--10.12846.7546
TG 50:3; [M+NH4]+@10.18TG 50:3ME224090--10.18846.7546
TG 50:4; [M+NH4]+@9.94TG 50:4ME224091--9.94844.739
TG 50:4; [M+NH4]+@9.97TG 50:4ME224092--9.97844.739
TG 50:5; [M+NH4]+@9.75TG 50:5ME224093--9.75842.7233
TG 50:5; [M+NH4]+@9.77TG 50:5ME224094--9.77842.7233
TG 51:1; [M+NH4]+@10.14TG 51:1ME224095--10.14864.8015
TG 51:1; [M+NH4]+@10.71TG 51:1ME224096--10.71864.8015
TG 51:1; [M+NH4]+@10.75TG 51:1ME224097--10.75864.8015
TG 51:2; [M+NH4]+@10.53TG 51:2ME224098--10.53862.7859
TG 51:2; [M+NH4]+@10.55TG 51:2ME224099--10.55862.7859
TG 51:2; [M+NH4]+@9.87TG 51:2ME224100--9.87862.7859
TG 51:3; [M+NH4]+@10.33TG 51:3ME224101--10.33860.7702
TG 51:3; [M+NH4]+@10.36TG 51:3ME224102--10.36860.7702
TG 51:3; [M+NH4]+@9.67TG 51:3ME224103--9.67860.7702
TG 51:4; [M+NH4]+@10.14TG 51:4ME224104--10.14858.7546
TG 52:0; [M+NH4]+@11.05TG 52:0ME224105--11.05880.8328
TG 52:0; [M+NH4]+@11.09TG 52:0ME224106--11.09880.8328
TG 52:1; [M+NH4]+@10.84TG 52:1ME224107--10.84878.8172
TG 52:1; [M+NH4]+@10.85TG 52:1ME224108--10.85878.8172
TG 52:2; [M+NH4]+@10.59TG 52:2ME224109--10.59876.8015
TG 52:2; [M+NH4]+@10.63TG 52:2ME224110--10.63876.8015
TG 52:3; [M+NH4]+@10.40TG 52:3ME224111--10.4874.7859
TG 52:3; [M+NH4]+@10.43TG 52:3ME224112--10.43874.7859
TG 52:4; [M+NH4]+@10.20TG 52:4ME224113--10.2872.7702
TG 52:4; [M+NH4]+@10.23TG 52:4ME224114--10.23872.7702
TG 52:4; [M+NH4]+@9.31TG 52:4ME224115--9.31872.7702
TG 52:5; [M+NH4]+@10.02TG 52:5ME224116--10.02870.7546
TG 52:5; [M+NH4]+@10.03TG 52:5ME224117--10.03870.7546
TG 52:5; [M+NH4]+@9.05TG 52:5ME224118--9.05870.7546
TG 52:6; [M+NH4]+@9.85TG 52:6ME224119--9.85868.739
TG 52:7; [M+NH4]+@9.65TG 52:7ME224120--9.65866.7233
TG 53:0; [M+NH4]+@11.18TG 53:0ME224121--11.18894.8484
TG 53:0; [M+NH4]+@11.20TG 53:0ME224122--11.2894.8484
TG 53:1; [M+NH4]+@10.40TG 53:1ME224123--10.4892.8328
TG 53:1; [M+NH4]+@10.95TG 53:1ME224124--10.95892.8328
TG 53:1; [M+NH4]+@10.98TG 53:1ME224125--10.98892.8328
TG 53:2; [M+NH4]+@10.05TG 53:2ME224126--10.05890.8172
TG 53:2; [M+NH4]+@10.75TG 53:2ME224127--10.75890.8172
TG 53:2; [M+NH4]+@10.79TG 53:2ME224128--10.79890.8172
TG 53:3; [M+NH4]+@10.56TG 53:3ME224129--10.56888.8015
TG 53:3; [M+NH4]+@10.59TG 53:3ME224130--10.59888.8015
TG 53:4; [M+NH4]+@10.37TG 53:4ME224131--10.37886.7859
TG 53:4; [M+NH4]+@10.40TG 53:4ME224132--10.4886.7859
TG 53:5; [M+NH4]+@10.18TG 53:5ME224133--10.18884.7702
TG 53:5; [M+NH4]+@10.20TG 53:5ME224134--10.2884.7702
TG 53:6; [M+NH4]+@9.98TG 53:6ME224135--9.98882.7546
TG 54:0; [M+NH4]+@11.30TG 54:0ME224136--11.3908.8641
TG 54:0; [M+NH4]+@11.33TG 54:0ME224137--11.33908.8641
TG 54:1; [M+NH4]+@11.07TG 54:1ME224138--11.07906.8484
TG 54:1; [M+NH4]+@11.11TG 54:1ME224139--11.11906.8484
TG 54:2; [M+NH4]+@10.87TG 54:2ME224140--10.87904.8328
TG 54:2; [M+NH4]+@10.90TG 54:2ME224141--10.9904.8328
TG 54:3; [M+NH4]+@10.67TG 54:3ME224142--10.67902.8172
TG 54:3; [M+NH4]+@10.70TG 54:3ME224143--10.7902.8172
TG 54:4; [M+NH4]+@10.46TG 54:4ME224144--10.46900.8015
TG 54:4; [M+NH4]+@10.48TG 54:4ME224145--10.48900.8015
TG 54:5; [M+NH4]+@10.26TG 54:5ME224146--10.26898.7859
TG 54:5; [M+NH4]+@10.29TG 54:5ME224147--10.29898.7859
TG 54:5; [M+NH4]+@9.36TG 54:5ME224148--9.36898.7859
TG 54:6; [M+NH4]+@10.09TG 54:6ME224149--10.09896.7702
TG 54:7; [M+NH4]+@9.92TG 54:7ME224150--9.92894.7546
TG 54:7; [M+NH4]+@9.93TG 54:7ME224151--9.93894.7546
TG 54:8; [M+NH4]+@9.73TG 54:8ME224152--9.73892.739
TG 55:0; [M+NH4]+@11.41TG 55:0ME224153--11.41922.8797
TG 55:1; [M+NH4]+@11.18TG 55:1ME224154--11.18920.8641
TG 55:2; [M+NH4]+@10.96TG 55:2ME224155--10.96918.8484
TG 55:3; [M+NH4]+@10.78TG 55:3ME224156--10.78916.8328
TG 55:4; [M+NH4]+@10.61TG 55:4ME224157--10.61914.8172
TG 55:5; [M+NH4]+@10.46TG 55:5ME224158--10.46912.8015
TG 55:6; [M+NH4]+@10.29TG 55:6ME224159--10.29910.7859
TG 55:7; [M+NH4]+@10.11TG 55:7ME224160--10.11908.7702
TG 56:0; [M+NH4]+@11.59TG 56:0ME224161--11.59936.8954
TG 56:1; [M+NH4]+@11.32TG 56:1ME224162--11.32934.8797
TG 56:1; [M+NH4]+@11.35TG 56:1ME224163--11.35934.8797
TG 56:2; [M+NH4]+@11.06TG 56:2ME224164--11.06932.8641
TG 56:2; [M+NH4]+@11.13TG 56:2ME224165--11.13932.8641
TG 56:3; [M+NH4]+@10.90TG 56:3ME224166--10.9930.8484
TG 56:3; [M+NH4]+@10.93TG 56:3ME224167--10.93930.8484
TG 56:4; [M+NH4]+@10.73TG 56:4ME224168--10.73928.8328
TG 56:4; [M+NH4]+@10.76TG 56:4ME224169--10.76928.8328
TG 56:5; [M+NH4]+@10.58TG 56:5ME224170--10.58926.8172
TG 56:5; [M+NH4]+@10.60TG 56:5ME224171--10.6926.8172
TG 56:6; [M+NH4]+@10.40TG 56:6ME224172--10.4924.8015
TG 56:6; [M+NH4]+@10.43TG 56:6ME224173--10.43924.8015
TG 56:7; [M+NH4]+@10.22TG 56:7ME224174--10.22922.7859
TG 56:7; [M+NH4]+@10.24TG 56:7ME224175--10.24922.7859
TG 56:8; [M+NH4]+@10.04TG 56:8ME224176--10.04920.7702
TG 56:8; [M+NH4]+@10.05TG 56:8ME224177--10.05920.7702
TG 56:9; [M+NH4]+@9.85TG 56:9ME224178--9.85918.7546
TG 57:6; [M+NH4]+@10.53TG 57:6ME224179--10.53938.8172
TG 57:7; [M+NH4]+@10.39TG 57:7ME224180--10.39936.8015
TG 58:0; [M+NH4]+@11.86TG 58:0ME224181--11.86964.9267
TG 58:10; [M+NH4]+@9.97TG 58:10ME224182--9.97944.7702
TG 58:10; [M+NH4]+@9.98TG 58:10ME224183--9.98944.7702
TG 58:11; [M+NH4]+@9.80TG 58:11ME224184--9.8942.7546
TG 58:11; [M+NH4]+@9.81TG 58:11ME224185--9.81942.7546
TG 58:1; [M+NH4]+@11.59TG 58:1ME224186--11.59962.911
TG 58:2; [M+NH4]+@11.35TG 58:2ME224187--11.35960.8954
TG 58:2; [M+NH4]+@11.36TG 58:2ME224188--11.36960.8954
TG 58:3; [M+NH4]+@11.14TG 58:3ME224189--11.14958.8797
TG 58:3; [M+NH4]+@11.16TG 58:3ME224190--11.16958.8797
TG 58:4; [M+NH4]+@10.99TG 58:4ME224191--10.99956.8641
TG 58:5; [M+NH4]+@10.81TG 58:5ME224192--10.81954.8484
TG 58:5; [M+NH4]+@10.85TG 58:5ME224193--10.85954.8484
TG 58:6; [M+NH4]+@10.62TG 58:6ME224194--10.62952.8328
TG 58:6; [M+NH4]+@10.65TG 58:6ME224195--10.65952.8328
TG 58:7; [M+NH4]+@10.45TG 58:7ME224196--10.45950.8172
TG 58:7; [M+NH4]+@10.49TG 58:7ME224197--10.49950.8172
TG 58:8; [M+NH4]+@10.29TG 58:8ME224198--10.29948.8015
TG 58:8; [M+NH4]+@10.34TG 58:8ME224199--10.34948.8015
TG 58:9; [M+NH4]+@10.15TG 58:9ME224200--10.15946.7859
TG 58:9; [M+NH4]+@10.16TG 58:9ME224201--10.16946.7859
TG 60:10; [M+NH4]+@10.24TG 60:10ME224202--10.24972.8015
TG 60:11; [M+NH4]+@10.05TG 60:11ME224203--10.05970.7859
TG 60:12; [M+NH4]+@9.90TG 60:12ME224204--9.9968.7702
TG 60:6; [M+NH4]+@10.83TG 60:6ME224205--10.83980.8641
TG 60:8; [M+NH4]+@10.52TG 60:8ME224206--10.52976.8328
TG 60:9; [M+NH4]+@10.37TG 60:9ME224207--10.37974.8172
TG 62:13; [M+NH4]+@9.96TG 62:13ME224208--9.96994.7859
TG 62:14; [M+NH4]+@9.85TG 62:14ME224209--9.85992.7702
TG 62:1; [M+NH4]+@12.22TG 62:1ME224210--12.221018.9736


Analysis: C18 POSITIVE ION MODE/Triple quadrupole

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
12:1 CARNITINECAR 12:1ME22430687087953---
14:1 CARNITINECAR 14:1ME22430787088002---
14:2 CARNITINECAR 14:2ME22430587087940---
16:1 CARNITINECAR 16:1ME22430376040365---
18:3 CARNITINECAR 18:3ME22429354500892---
3-HYDROXYLAUROYLCARNITINECAR 12:0;OHME22429971464535---
3-HYDROXYLINOLEYLCARNITINECAR 18:2;OHME22430271464556---
3-HYDROXYMYRISTOYLCARNITINECAR 14:0;OHME22430071464541---
3-HYDROXYPALMITOYLCARNITINECAR 16:0;3OHME22430171464553---
8:1 CARNITINECAR 8:1ME22430477908888---
AC1MIY4G-ME2242893082079---
ACETYL-DL-CARNITINECAR 2:0ME2242811---
ARACHIDONYL CARNITINECAR 20:4ME22429053477832---
ARACHIDYL CARNITINECAR 20:0ME22429153477833---
BUTYRYLCARNITINECAR 4:0ME224287213144---
CIS-4-DECENOYL CARNITINECAR 10:1ME22429457357170---
DECANOYLCARNITINECAR 10:0ME22428210245190---
DL-CARNITINECarnitineME224288288---
GLUTARYLCARNITINECAR DC5:0ME22429871317118---
ISOVALERYLCARNITINECAR 4:0;3MeME2242956426851---
LAUROYLCARNITINECAR 12:0ME22428310427569---
LINOELAIDYL CARNITINECAR 18:2(9E,12E)ME22429253477834---
L-PALMITOYLCARNITINECAR 16:0ME22428511953816---
MYRISTOYLCARNITINECAR 14:0ME2242966426854---
OLEOYLCARNITINECAR 18:1ME2242976441392---
O-OCTANOYLCARNITINECAR 8:0ME224286123701---
PROPIONYLCARNITINECAR 3:0ME224284107738---


Analysis: C18 POSITIVE ION MODE/Triple quadrupole

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
(11Z,14Z)-ICOSADIENOYLCARNITINECAR 20:2ME22432671464509---
12:1 CARNITINECAR 12:1ME22433487087953---
14:1 CARNITINECAR 14:1ME22433587088002---
14:2 CARNITINECAR 14:2ME22433387087940---
16:1 CARNITINECAR 16:1ME22433176040365---
18:3 CARNITINECAR 18:3ME22431954500892---
3-HYDROXYLAUROYLCARNITINECAR 12:0;OHME22432771464535---
3-HYDROXYLINOLEYLCARNITINECAR 18:2;OHME22433071464556---
3-HYDROXYMYRISTOYLCARNITINECAR 14:0;OHME22432871464541---
3-HYDROXYPALMITOYLCARNITINECAR 16:0;3OHME22432971464553---
8:1 CARNITINECAR 8:1ME22433277908888---
AC1MIY4G-ME2243163082079---
ACETYL-DL-CARNITINECAR 2:0ME2243081---
ARACHIDONYL CARNITINECAR 20:4ME22431753477832---
BUTYRYLCARNITINECAR 4:0ME224314213144---
CIS-4-DECENOYL CARNITINECAR 10:1ME22432057357170---
DECANOYLCARNITINECAR 10:0ME22430910245190---
DL-CARNITINECarnitineME224315288---
GLUTARYLCARNITINECAR DC5:0ME22432571317118---
ISOVALERYLCARNITINECAR 4:0;3MeME2243216426851---
LAUROYLCARNITINECAR 12:0ME22431010427569---
LINOELAIDYL CARNITINECAR 18:2(9E,12E)ME22431853477834---
L-PALMITOYLCARNITINECAR 16:0ME22431211953816---
MYRISTOYLCARNITINECAR 14:0ME2243226426854---
OLEOYLCARNITINECAR 18:1ME2243246441392---
O-OCTANOYLCARNITINECAR 8:0ME224313123701---
PROPIONYLCARNITINECAR 3:0ME224311107738---
STEAROYLCARNITINECAR 18:0ME2243236426855---


Analysis: HILIC NEGATIVE ION MODE/Amino, Aminopropyl

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
ADENOSINEAdenosineME22434260961---
DL-ASPARTIC ACIDAspartic acidME224338424---
DL-GLUTAMIC ACIDGlutamic acidME224343611---
HEXOPYRANOSEHexoseME224337206---
L-GLUTAMINEGlutamineME2243415961---
OLEIC ACIDOleic acidME224339445639---
STEARIC ACIDStearic acidME2243405281---
XANTHINEXanthineME2243361188---


Analysis: HILIC NEGATIVE ION MODE/Nucleotides, Sugars

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2-KETOGLUTARIC ACID2-Oxoglutaric acidME22435351---
6-PHOSPHOGLUCONIC ACID6-Phosphogluconic acidME22436691493---
ADENOSINE 5'-DIPHOSPHATEADPME2243586022---
ADENOSINE 5'-MONOPHOSPHATEAMPME2243596083---
ADENOSINE TRIPHOSPHATEATPME2243555957---
BETA-NAD+NAD+ME22434615938971---
CITRIC ACIDCitric acidME224350311---
COENZYME IINADP+ME22434715938972---
D-ERYTHROSE 4-PHOSPHATEErythrose 4-phosphateME224345122357---
D-FRUCTOSE, 1,6-BIS(DIHYDROGEN PHOSPHATE)Fructose 1,6-bisphosphateME22434921125049---
DIHYDROXYACETONE PHOSPHATEDihydroxyacetone phosphateME224361668---
FADFADME22435246906035---
GLYCERALDEHYDE 3-PHOSPHATEGlyceraldehyde 3-phosphateME224363729---
GLYCERATE 3-PHOSPHATE3-Phosphoglyceric acidME224362724---
HYPOXANTHINEHypoxanthineME224365790---
LACTIC ACIDLactic acidME224360612---
MALIC ACIDMalic acidME224354525---
NADHNADHME224351439153---
PHOSPHOENOLPYRUVATEPhosphoenolpyruvic acidME2243441005---
RIBOSE PHOSPHATERibose 5-phosphateME22436477982---
ROBISON ESTERGlucose 6-phosphateME2243565958---
SEDOHEPTULOSE 7-PHOSPHATESedoheptulose 7-phosphateME224348165007---
SUCROSESucroseME2243575988---


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